SCHEMBL13161963

SCHEMBL13161963

Cc1ccccc1C(=O)NC1CN(C)C1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
SMN1; SMN2 Q16637 2/20 0.61
GLA P06280 1/20 0.61
POLB P06746 3/20 0.56
KMT2A Q03164 6/20 0.53
MEN1 O00255 4/20 0.53
ALDH1A1 P00352 2/20 0.53
ALOX15 P16050 1/20 0.52
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
HTR7 P34969 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3333337 0.88 NPC1 (0.62) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL3317179 0.84 NPC1 (0.61) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL3329899 0.84 NPC1 (0.70) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL457993 0.83 NPC1 (0.84) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL30200324 0.83 GAA (0.56) NPC1RAB9ASMN1; SMN2POLBKMT2A
SCHEMBL14722816 0.81 SMN1; SMN2 (0.78) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL13162659 0.80 NPC1 (0.97) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL13162641 0.80 NPC1 (0.90) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL13164090 0.80 NPC1 (0.69) NPC1RAB9ASMN1; SMN2GLAPOLB
SCHEMBL29860179 0.79 TP53 (0.56) GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206707-B1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-07-23 EP disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2010-09-30 US disclosed
EP-2206707-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2010-07-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF TRPV1, FGFR3, GPR17 NPC1 4144/4885RAB9A 4223/4885SMN1; SMN2 3213/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.